UCSF

ZINC40343726

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2010 29 Yes

Popular Name: (4R)-3-(4-chlorophenyl)-5-(2-morpholinoethyl)-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one (4R)-3-(4-chlorophenyl)-5-(2-mor…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.46 7.29 -10.78 1 6 0 61 428.945 5 ↓
Lo Low (pH 4.5-6) 3.46 9.55 -48.42 2 6 1 63 429.953 5 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.